Basic information
- Standard SMILES
CC(C)C(=O)Nc1cccc(C2CCN(CC(Oc3cccc(Cl)c3)c3ccccc3)CC2)c1- InChIKey
PCRLWAOBJGRYND-UHFFFAOYSA-N- Molecular formula
- C29H33ClN2O2
- Average molar mass
- 477 g/mol
- Monoisotopic mass
- 476.223056
Names & identifiers
- Preferred name
- N-[3-[1-[2-(3-chlorophenoxy)-2-phenylethyl]piperidin-4-yl]phenyl]-2-methylpropanamide
- IUPAC
- N-[3-[1-[2-(3-chlorophenoxy)-2-phenylethyl]piperidin-4-yl]phenyl]-2-methylpropanamide
Names & synonyms
SCHEMBL6248462
Database identifiers
- PubChem CID
- 22048834
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 615
Related reactions
1 records
Compound notes
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